BAS 00229101
TL;DR: BAS 00229101 (CAS 297763-82-7) is a chemical compound with molecular formula C25H35N3O2S and molecular weight 441.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzamido-N-[5-(diethylamino)pentan-2-yl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Also Known As: BAS 00229101, 2-benzamido-N-[5-(diethylamino)pentan-2-yl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide, N-[5-(diethylamino)pentan-2-yl]-2-[(phenylcarbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
| Molecular Formula | C25H35N3O2S |
|---|---|
| Molecular Weight | 441.25 g/mol |
| LogP | 5.1195 |
| Topological Polar Surface Area | 61.44 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 441.245 |
| Heavy Atoms | 31 |
| Complexity | 874.39233 |
Chemical Identifiers
| CAS Number | 297763-82-7 |
|---|---|
| SMILES | CCN(CC)CCCC(C)NC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=CC=CC=C3 |
Product Overview
BAS 00229101 (CAS 297763-82-7), with molecular formula C25H35N3O2S and molecular weight 441.25 g/mol. IUPAC: 2-benzamido-N-[5-(diethylamino)pentan-2-yl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide.
Chemical Property Profile of BAS 00229101
Property Insights of BAS 00229101
The XLogP value of 5.1195 indicates that BAS 00229101 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.44 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00229101. Following Lipinski's Rule of Five, BAS 00229101 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00229101?
The CAS number of BAS 00229101 is 297763-82-7.
What is the molecular formula of BAS 00229101?
The molecular formula of BAS 00229101 is C25H35N3O2S.
What is the molecular weight of BAS 00229101?
The molecular weight of BAS 00229101 is 441.25 g/mol.
Where can I buy BAS 00229101?
You can request a quote for BAS 00229101 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00229101?
Yes, KEHONG BIO provides custom synthesis services for BAS 00229101 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.